2-(2-chlorophenyl)ethanol;ethane

C10H15ClO — CID 142279480

IUPAC2-(2-chlorophenyl)ethanol;ethane
SMILESCC.OCCc1ccccc1Cl
InChIInChI=1S/C8H9ClO.C2H6/c9-8-4-2-1-3-7(8)5-6-10;1-2/h1-4,10H,5-6H2;1-2H3
InChIKeyAKPNOMLNDLHHGV-UHFFFAOYSA-N
MW186.68 g/mol
LogP2.90
Rot. Bonds2

About 2-(2-chlorophenyl)ethanol;ethane

2-(2-chlorophenyl)ethanol;ethane (PubChem CID 142279480) has the molecular formula C10H15ClO and a molecular weight of 186.68 g/mol. Its IUPAC name is 2-(2-chlorophenyl)ethanol;ethane.

Molecular Properties

Compound Name2-(2-chlorophenyl)ethanol;ethane
PubChem CID142279480
Molecular FormulaC10H15ClO
Molecular Weight186.68 g/mol
Exact Mass186.08
IUPAC Name2-(2-chlorophenyl)ethanol;ethane
SMILESCC.OCCc1ccccc1Cl
InChIInChI=1S/C8H9ClO.C2H6/c9-8-4-2-1-3-7(8)5-6-10;1-2/h1-4,10H,5-6H2;1-2H3
InChIKeyAKPNOMLNDLHHGV-UHFFFAOYSA-N
XLogP2.90
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.68
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[2-(2-chlorophenyl)ethyl-propylamino]ethanol
CID 110909893
1-chloro-2-(2-chloroethyl)benzene
CID 12587535
2-[3-(2-chlorophenyl)propylamino]ethanol
CID 70464320
(2-chlorophenyl)-dideuteriomethanol
CID 142596700
4-amino-1-(2-chlorophenyl)pentan-3-ol
CID 83924263
2-[3-chloro-2-(1-fluoroethyl)phenyl]ethanol
CID 117291223
azane;1-butyl-2-chlorobenzene
CID 19011342
ethane;2-naphthalen-1-ylethanol
CID 145119048
1-chloro-2-(2-phenylethyl)benzene
CID 21495838
azane;2-(2-chlorophenyl)ethanamine
CID 70087147
2-(2-chlorophenyl)-N-[2-(2-chlorophenyl)ethyl]ethanamine
CID 70453735
1-(2-chlorophenyl)-4-methylpentan-3-one
CID 43370393

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)ethanol;ethane?
The IUPAC name of 2-(2-chlorophenyl)ethanol;ethane (CID 142279480) is 2-(2-chlorophenyl)ethanol;ethane.
What is the SMILES notation for 2-(2-chlorophenyl)ethanol;ethane?
The canonical SMILES for 2-(2-chlorophenyl)ethanol;ethane is CC.OCCc1ccccc1Cl.
What is the InChIKey of 2-(2-chlorophenyl)ethanol;ethane?
The InChIKey is AKPNOMLNDLHHGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9ClO.C2H6/c9-8-4-2-1-3-7(8)5-6-10;1-2/h1-4,10H,5-6H2;1-2H3.
What are the key properties of 2-(2-chlorophenyl)ethanol;ethane?
2-(2-chlorophenyl)ethanol;ethane has a molecular weight of 186.68 g/mol, XLogP of 2.90, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)ethanol;ethane is sourced from PubChem (CID 142279480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).